SCHEMBL29556163

SCHEMBL29556163

O=C(Nc1cccc(Cl)c1)Nc1cc(F)nc(F)c1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 13/20 0.72
▸ MEN1 O00255 11/20 0.72
▸ LMNA P02545 6/20 0.72
▸ MAPT P10636 6/20 0.72
▸ HTT P42858 3/20 0.72
▸ ALDH1A1 P00352 2/20 0.72
▸ RAB9A P51151 8/20 0.69
▸ NPC1 O15118 6/20 0.66
▸ POLB P06746 1/20 0.57
▸ GRM5 P41594 1/20 0.56
▸ SMN1; SMN2 Q16637 3/20 0.56
▸ CYP1A2 P05177 1/20 0.56
▸ CYP3A4 P08684 1/20 0.56
▸ KDR P35968 1/20 0.56
▸ TP53 P04637 1/20 0.55
▸ TSHR P16473 1/20 0.55
▸ NFKB1 P19838 1/20 0.55
▸ NFKB2 Q00653 1/20 0.55
▸ RELA Q04206 1/20 0.55
▸ L3MBTL1 Q9Y468 1/20 0.55

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL29556199 0.85 KMT2A (0.68) KMT2AMEN1LMNAMAPTHTT
SCHEMBL2682054 0.85 KMT2A (1.00) KMT2AMEN1LMNAMAPTHTT
SCHEMBL29556085 0.84 RAB9A (0.64) KMT2AMEN1LMNAMAPTRAB9A
SCHEMBL29556162 0.83 MEN1 (0.89) KMT2AMEN1LMNAMAPTHTT
SCHEMBL29077780 0.83 MEN1 (0.89) KMT2AMEN1LMNAMAPTHTT
SCHEMBL29555917 0.83 MEN1 (0.82) KMT2AMEN1LMNAMAPTHTT
SCHEMBL29556404 0.81 MEN1 (0.51) KMT2AMEN1LMNAMAPTHTT
SCHEMBL17286236 0.81 MEN1 (0.77) KMT2AMEN1LMNAMAPTHTT
SCHEMBL11007034 0.81 MEN1 (0.79) KMT2AMEN1LMNAMAPTHTT
SCHEMBL10344695 0.80 MEN1 (1.00) KMT2AMEN1LMNAMAPTHTT

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022078533-A1 SUBSTITUTED 1,3-DIPHENYLUREA DERIVATIVES AND 1-PHENYL-3-PYRIDYLUREA DERIVATIVES FOR PLANT BIOTECHNOLOGY, PREPARATIONS CONTAINING THESE COMPOUNDS AND USE THEREOF USTAV EXPERIMENTALNI BOTANIKY AV CR, V.V.I. (CZ) 2022-04-21 — — WO disclosed
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